COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK360668
Chemical Name: methyl3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl}thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1S(=O)(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 424.5
Empirical Formula: C18H20N2O6S2

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 2.509
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 122
Number of rings: 4

     

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